(2-phenyl-4,5-dihydro-1,3-oxazol-4-yl)methyl 4-methylbenzenesulfonate

Systemtic Name: (2-phenyl-4,5-dihydro-1,3-oxazol-4-yl)methyl 4-methylbenzenesulfonate Openeye Name: (2-phenyl-4,5-dihydrooxazol-4-yl)methyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (2-phenyl-4,5-dihydrooxazol-4-yl)methyl ester IUPAC Name: (2-phenyl-4,5-dihydro-1,3-oxazol-4-yl)methyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (2-phenyl-2-oxazolin-4-yl)methyl ester Formula: C17H17NO4S MolecularWeight: 331.38618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC2COC(=N2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC2COC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C17H17NO4S/c1-13-7-9-16(10-8-13)23(19,20)22-12-15-11-21-17(18-15)14-5-3-2-4-6-14/h2-10,15H,11-12H2,1H3